SCHEMBL5729792

SCHEMBL5729792

Nc1ccc2c(c1N)OC(CO)CC2

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 8/20 0.34
NFKB2 Q00653 8/20 0.34
RELA Q04206 8/20 0.34
DRD2 P14416 5/20 0.32
DRD4 P21917 5/20 0.32
DRD3 P35462 5/20 0.32
GRM2 Q14416 2/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14092141 0.81 L3MBTL1 (0.35) NFKB1NFKB2RELAGRM2
SCHEMBL7850920 0.79 ALDH1A1 (0.37) NFKB1NFKB2RELA
SCHEMBL27605201 0.75 DRD2 (0.33) NFKB1NFKB2RELADRD2DRD4
SCHEMBL7110632 0.72 CHRM3 (0.40) DRD2DRD3
SCHEMBL7110625 0.72 CHRM3 (0.40) DRD2DRD3
SCHEMBL6749348 0.72 NFKB1 (0.62) NFKB1NFKB2RELA
SCHEMBL14046826 0.72 L3MBTL1 (0.36) NFKB1NFKB2RELA
SCHEMBL6636676 0.71 DRD2 (0.42) DRD2DRD4DRD3
SCHEMBL14046830 0.71 L3MBTL1 (0.38) NFKB1NFKB2RELADRD2DRD4
SCHEMBL8902349 0.71 DRD2 (0.42) DRD2DRD4DRD3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120202243-A Thermosetting resin composition, cured film, substrate, and electronic component 捷恩智株式会社 2025-06-24 CN disclosed
CN-100369916-C 2-(aminomethyl)-tetrahydro-9-oxa-1,3-diaza-cyclopenta[a]-naphthalenyl derivatives with antipsychotic activity WYETH CORP (US) 2008-02-20 CN disclosed
EP-1409490-B1 2-(AMINOMETHYL)-TETRAHYDRO-9-OXA-1,3-DIAZA-CYCLOPENTA A|NAPHTHALENYL DERIVATIVES WITH ANTIPSYCHOTIC ACTIVITY WYETH CORP (US) 2006-09-06 EP disclosed
EP-1421086-B1 2-(AMINOMETHYL)-TETRAHYDRO-9-OXA-1,3-DIAZA-CYCLOPENTA a|NAPHTHALENYL DERIVATIVES WITH ANTIPSYCHOTIC ACTIVITY WYETH CORP (US) 2006-08-30 EP disclosed
CN-1555377-A 2-(aminomethyl)-tetrahydro-9-oxa-1,3-diaza-cyclopenta[a]-naphthalenyl derivatives with antipsychotic activity 2004-12-15 CN disclosed
EP-1421086-A1 2-(AMINOMETHYL)-TETRAHYDRO-9-OXA-1,3-DIAZA-CYCLOPENTA a]NAPHTHALENYL DERIVATIVES WITH ANTIPSYCHOTIC ACTIVITY Wyeth (US) 2004-05-26 EP disclosed
EP-1409490-A1 2-(AMINOMETHYL)-TETRAHYDRO-9-OXA-1,3-DIAZA-CYCLOPENTA A]NAPHTHALENYL DERIVATIVES WITH ANTIPSYCHOTIC ACTIVITY Wyeth (US) 2004-04-21 EP disclosed
US-6541501-B2 Dopamine autoreceptor agonists WYETH 2003-04-01 US disclosed
US-6541502-B1 Treatment of disorders associated with dopamine dysregulation such as schizophrenia WYETH 2003-04-01 US disclosed
US-20030037701-A1 2-(AMINOMETHYL)-TETRAHYDRO-9-OXA-1,3-DIAZA-CYCLOPENTA[A]-NAPHTHALENYL DERIVATIVES WITH ANTIPSYCHOTIC ACTIVITY WYETH 2003-02-27 US disclosed
WO-2003008420-A1 2-(AMINOMETHYL)-TETRAHYDRO-9-OXA-1,3-DIAZA-CYCLOPENTA[A]NAPHTHALENYL DERIVATIVES WITH ANTIPSYCHOTIC ACTIVITY WYETH (US) 2003-01-30 WO disclosed
WO-2003008419-A1 2-(AMINOMETHYL)-TETRAHYDRO-9-OXA-1,3-DIAZA-CYCLOPENTA[a]NAPHTHALENYL DERIVATIVES WITH ANTIPSYCHOTIC ACTIVITY WYETH (US) 2003-01-30 WO disclosed